CHEMICAL COMPOSITION OF AGARWOOD OIL IOO

(Scientific interpretation of original data of GCMS analysis)

Instruments: GC/MS TRACE GC ULTRA, Hanoi University of Science and Technology

Library database: Nist169, Nist 98.L, Wiley7n.1, HOP CHAT THOM.L
Sample: Indonesia oud oil (provided by Mr.Arthur Low)
Sample code: IOO (Abbreviation: I stands for Indonesia, O stands for Oud, O stands for Oil)
Source tree: Aquilaria tree Kalimantan, Indonesia
Operator: Mr. Nguyen Anh Vu (PhD)
Scientific interpretation of original data: Mr. Dinh xuan Ba (Prof.)
Date: 05 June 2016

Molecular
* Content Structural
No. IUPAC name & preferred common names CAS# Formula/Weight Notes
(%) Formular
(g/mol)

Guaiene, beta-; GUAIENE; Guaia-

1(5),7(11)-diene; Azulene, 1,2,3,4,5,6,7,8-
octahydro-1,4-dimethyl-7-(1- 88-84-6 C15H24 Sesquiterpene
1 29.93
methylethylidene)-, (1S-cis)-; 1,4- 34766-41-1 204.35106 (9)
dimethyl-7-propan-2-ylidene-2,3,4,5,6,8-
hexahydro-1H-azulene;
alpha-Cadinene; Naphthalene,
1,2,4a,5,6,8a-hexahydro-4,7-dimethyl-1-
(1-methylethyl)-, [1S- C15H24
(1.alpha.,4a.beta.,8a.alpha.)]-; Cadina-4,9- Sesquiterpene
2
diene-, (-)-;(-)--Cadinene; (1S,4aR,8aR)-
20.14 24406-05-1 204.3511 (2)
4,7-dimethyl-1-propan-2-yl-
1,2,4a,5,6,8a-hexahydronaphthalene;
(+)-alpha-cadinene;

1
 Aristolene; (-)-Aristolene; Aristol-9-ene;
1,1,7,7a-tetramethyl-2,4,5,6,7,7b- C15H24 Sesquiterpene
3 8.32 6831-16-9
hexahydro-1aH- 204.35106
cyclopropa[a]naphthalene;

Selina-3,7(11)-diene; 3,7(11)-selinadiene;
Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-
4a,8-dimethyl-2-(1-methylethylidene)-, C15H24 Sesquiterpene
4 6.95 6813-21-4
(4aR-trans)-; Eudesma-3,7(11)-diene; 4a,8- 204.35106
Dimethyl-2-(1-methylethylidene)-
1,2,3,4,4a,5,6,8a-octahydronaphthalene;

1H-Cyclopropa[a]naphthalene, decahydro-
C15H24 Sesquiterpene
5 1,1,3a-trimethyl-7-methylene-, [1aS- 6.81 20071-49-2 204.3511
(1a,3a,7a,7b)]-; gamma-Maaliene;

gamma-himachalene; 2,5,9,9-tetramethyl-
3,4,4a,7,8,9a-
hexahydrobenzocycloheptene; 2,5,9,9-
6 5.27 N/A C15H24 Sesquiterpene
tetramethyl-3,4,4a,7,8,9a- 204.35106 g/mol (6)
hexahydrobenzo[7]annulene; himachal-
4,10-diene; 2,7-Himachaladiene;

2
 2-(4a,8-Dimethyl-1,2,3,4,4a,5,6,7-
octahydro-naphthalen-2-yl)-prop-2-en-1-
C15H24O Sesquiterpenoid
7 ol; 2-(4a,8-dimethyl-2,3,4,5,6,7- 3.94
N/A 220.35046 (2)
hexahydro-1H-naphthalen-2-yl)prop-2-
en-1-ol;
Octasiloxane,
1,1,3,3,5,5,7,7,9,9,11,11,13,13,15,15-
hexadecamethyl-; [[[[[[(dimethyl-$l^{3}- Methanolic fruit
silanyl)oxy-dimethylsilyl]oxy- extract of Garcinia
C16H48O7Si8
8 dimethylsilyl]oxy-dimethylsilyl]oxy- 3.5 19095-24-0 cambogia (edible
577.23212 g/mol
dimethylsilyl]oxy-dimethylsilyl]oxy- fruit)
dimethylsilyl]oxy-dimethylsilicon; 1,15- (2)
Dihydrogenhexadecamethyloctasiloxane;
1,15-Dihydrohexadecamethyloctasiloxane;
Cyclooctasiloxane, hexadecamethyl-; TSCA candidate list
Hexadecamethyl-cyclooctasioxane; of Chemical
2,2,4,4,6,6,8,8,10,10,12,12,14,14,16,16- C16H48O8Si8
9 2.49 556-68-3 substances (TSCA:
hexadecamethyl-1,3,5,7,9,11,13,15- 593.23152 g/mol Toxic Substances
octaoxa-2,4,6,8,10,12,14,16- Control Act)
octasilacyclohexadecane; (2)
Androstan-17-one, 3-ethyl-3-hydroxy-,
(5.alpha.)-; 3-Ethyl-3-hydroxyandrostan- C21H34O2
17-one; 3-ethyl-3-hydroxy-10,13-
10 2.39 N/A 318.49346 g/mol
dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-
dodecahydro-1H-
cyclopenta[a]phenanthren-17-one;

3
 C29H42O
3-Oxatricyclo[20.8.0.0(7,16)]triaconta-
11 2.11 N/A 406.64318 g/mol (5)
1(22),7(16),9,13,23,29-hexaene;

C15H24O/ Sesquiterpenoid
12 Isolongifolene, 7,8-dehydro-8a-hydroxy- 2.10 N/A
220.35046

7-Tetracyclo[6.2.1.0(3.8)0(3.9)]undecanol,
13 4,4,11,11-tetramethyl-; (+)- 2.05 N/A C15H24O Sesquiterpenoid
Cycloisolongifol-5-ol; 220.35046 g/mol (2)

Digitoxin; Acedoxin; Carditoxin;

Coramedan; Digitalinum;
Digitoksin; Digitophyllin;
Digitrin; Ditaven;
Monodigitoxoside; Mono-
1339-93-1
glycocard; Myodigin; Natigal; Digitoxin is an
1367-39-1 C41H64O13
Purodigin; Purodigin, extremely
14 1.88 1391-34-0 71-
crystalline; Purpurid; Tardigal; Unidigin; 764.93906 g/mol hazardous
63-6
Cardidigin; 3- substance (EHS)
82476-56-0
[(3S,5R,8R,9S,10S,13R,14S,17S)-3-
[(2R,4S,5S,6R)-5-[(2S,4S,5S,6R)-5-
[(2S,4S,5S,6R)-4,5-dihydroxy-6-
methyloxan-2-yl]oxy-4-hydroxy-6-
methyloxan-2-yl]oxy-4-hydroxy-6-

4
 methyloxan-2-yl]oxy-14-hydroxy-10,13-
dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-
tetradecahydrocyclopenta[a]phenanthre
n-17-yl]-2H-furan-5-one; XMO 10;
Crystodigin;
Octasiloxane,
1,1,3,3,5,5,7,7,9,9,11,11,13,13,15,15-
hexadecamethyl-;
Methanolic fruit
1,1,3,3,5,5,7,7,9,9,11,11,13,13,15,15-
extract of Garcinia
Hexadecamethyloctasiloxane; C16H48O7Si8
15 0.89 N/A cambogia (edible
[[[[[[(dimethyl-$l^{3}-silanyl)oxy- 577.23212 g/mol fruit)
dimethylsilyl]oxy-dimethylsilyl]oxy-
(2)
dimethylsilyl]oxy-dimethylsilyl]oxy-
dimethylsilyl]oxy-dimethylsilyl]oxy-
dimethylsilicon;
123536-30-1
3-Buten-2-ol, 4-phenyl-; 4-Phenyl-3-buten-
1504-55-8
2-ol; alpha-Methylcinnamyl alcohol; C10H12O
16 0.67 17488-65-2
Methyl cinnamic alcohol; Methyl styryl
36004-04-3 148.20168 g/mol
carbinol; (E)-4-phenylbut-3-en-2-ol;

Derivative of
Cedran-diol, 8S,14-; Cedrane-8,13-diol; 62600-05-9 C15H26O2
17 0.56 Sesquiterpene
Cedran-diol, 8S,13- 88588-48-1 238.366
alcohol

Total 100
Notes: - (*) IUPAC name written in bold letter, compound names are separated by semi-colon (;)
- CAS: Chemical Abstracts Service
- Chromatogram of IOO (see attached Appendix)

5
Classification of compounds: Sesquiterpenes (77.42%), Sesquiterpenoids (8.09%), derivative of Sesquiterpene alcohol (0.56%),
Aromatic ketone (0.00%), Fatty acid (0.00%). No allergen, no toxin from Phthalate Esters but there is 4.37% toxic chemicals (in
which 1.88% is EHS). This agarwood essential oil is mixed with 4.39% extract of Garcinia cambogia fruit.

Conclusion: IOO sample is in acceptable quality of Agarwood essential oil, the total content of sesquiterpenes; sesquiterpenoids and
sesquiterpene derivatives is 86.07%. But it is a pitty that this IOO sample is mixed with a small amount of extract of Garcia cambogia
fruit and contains a small amount of Digitoxin which is an extremely hazardous substance.

SECOIN APPLIED BIOTECH CENTER

59 Hang Chuoi street, Hai Ba Trung district, Hanoi, Vietnam
227 Dien Bien Phu street, Ward 15, Binh Thanh district, HCMc
Tel: 84-4-39718899, 84913207676; URL: http://agarwood.ning.com
http://www.secoin.vn; E-mail: dxb@secoin.vn; secoinbio@secoin.vn

6
 Appendix
Chromatogram of IOO sample

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